N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine

C18H36N2 — CID 63469847

IUPACN-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine
SMILESCCCC1CCN(C2CCCCCCC2NCC)CC1
InChIInChI=1S/C18H36N2/c1-3-9-16-12-14-20(15-13-16)18-11-8-6-5-7-10-17(18)19-4-2/h16-19H,3-15H2,1-2H3
InChIKeyKLHYMPJAFUWVOC-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.20
Rot. Bonds5

About N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine

N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine (PubChem CID 63469847) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine
PubChem CID63469847
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC NameN-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine
SMILESCCCC1CCN(C2CCCCCCC2NCC)CC1
InChIInChI=1S/C18H36N2/c1-3-9-16-12-14-20(15-13-16)18-11-8-6-5-7-10-17(18)19-4-2/h16-19H,3-15H2,1-2H3
InChIKeyKLHYMPJAFUWVOC-UHFFFAOYSA-N
XLogP4.20
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-2-(4-propylpiperidin-1-yl)cycloheptan-1-amine
CID 63469846
N-ethyl-2-(3-propylpyrrolidin-1-yl)cycloheptan-1-amine
CID 113417305
N-ethyl-2-pyrrolidin-1-ylcyclododecan-1-amine
CID 63466183
N,4-diethyl-2-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 63469848
N-ethyl-2-(4-methylazepan-1-yl)cycloheptan-1-amine
CID 63624079
2-(4-propylpiperidin-1-yl)cycloheptan-1-ol
CID 62205599
2-[4-(methoxymethyl)piperidin-1-yl]-N-propylcycloheptan-1-amine
CID 63972305
N-ethyl-2-[3-(methoxymethyl)pyrrolidin-1-yl]cyclopentan-1-amine
CID 64569500
2-(4-butan-2-ylpiperazin-1-yl)-N-ethylcycloheptan-1-amine
CID 62774800
N-ethyl-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]cyclohexan-1-amine
CID 62967694
N-ethyl-2-(4-ethyl-4-methylpiperidin-1-yl)cyclohexan-1-amine
CID 63160766
2-(4-propan-2-ylpiperidin-1-yl)-N-propylcyclooctan-1-amine
CID 103494992

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine?
The IUPAC name of N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine (CID 63469847) is N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine.
What is the SMILES notation for N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine?
The canonical SMILES for N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine is CCCC1CCN(C2CCCCCCC2NCC)CC1.
What is the InChIKey of N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine?
The InChIKey is KLHYMPJAFUWVOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-3-9-16-12-14-20(15-13-16)18-11-8-6-5-7-10-17(18)19-4-2/h16-19H,3-15H2,1-2H3.
What are the key properties of N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine?
N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine has a molecular weight of 280.50 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-propylpiperidin-1-yl)cyclooctan-1-amine is sourced from PubChem (CID 63469847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).